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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:42 UTC
Update Date2025-03-25 00:59:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02237168
Frequency0.5
Structure
Chemical FormulaC15H19NO5
Molecular Mass293.1263
SMILESO=C(NC(Cc1ccccc1)C(=O)O)OCC1CCOC1
InChI KeyMUVLTMGMHVJXPK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent phenylalanine and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amphetamines and derivatives
  • benzene and substituted derivatives
  • carbamate esters
  • carbonyl compounds
  • carboxylic acids
  • dialkyl ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • phenylpropanoic acids
  • tetrahydrofurans
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • 3-phenylpropanoic-acid
  • dialkyl ether
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • organoheterocyclic compound
  • amphetamine or derivatives
  • carbonic acid derivative
  • tetrahydrofuran
  • carbamic acid ester
  • oxacycle
  • monocarboxylic acid or derivatives
  • phenylalanine or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound